2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide

C15H24N2O4S — CID 47064798

IUPAC2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide
SMILESCOc1cc(C)c(S(=O)(=O)N(CC(N)=O)CC(C)C)cc1C
InChIInChI=1S/C15H24N2O4S/c1-10(2)8-17(9-15(16)18)22(19,20)14-7-11(3)13(21-5)6-12(14)4/h6-7,10H,8-9H2,1-5H3,(H2,16,18)
InChIKeyFBPRTPPPHNDLBC-UHFFFAOYSA-N
MW328.43 g/mol
LogP1.44
Rot. Bonds7

About 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide

2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide (PubChem CID 47064798) has the molecular formula C15H24N2O4S and a molecular weight of 328.43 g/mol. Its IUPAC name is 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide.

Molecular Properties

Compound Name2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide
PubChem CID47064798
Molecular FormulaC15H24N2O4S
Molecular Weight328.43 g/mol
Exact Mass328.15
IUPAC Name2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide
SMILESCOc1cc(C)c(S(=O)(=O)N(CC(N)=O)CC(C)C)cc1C
InChIInChI=1S/C15H24N2O4S/c1-10(2)8-17(9-15(16)18)22(19,20)14-7-11(3)13(21-5)6-12(14)4/h6-7,10H,8-9H2,1-5H3,(H2,16,18)
InChIKeyFBPRTPPPHNDLBC-UHFFFAOYSA-N
XLogP1.44
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-amino-2-methylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide
CID 61115794
N-(1-aminopropan-2-yl)-4-methoxy-N,2,5-trimethylbenzenesulfonamide
CID 119982633
5-amino-N-ethyl-2-methoxy-4-methyl-N-(2-methylpropyl)benzenesulfonamide
CID 79973709
N,N-diethyl-5-methoxy-2,4-dimethylbenzenesulfonamide
CID 2284278
N-(2-aminoethyl)-4-methoxy-N,2,5-trimethylbenzenesulfonamide
CID 28707568
2-methoxy-5-methyl-N,N-bis(2-methylpropyl)benzenesulfonamide
CID 166187507
2-[(3-amino-5-methylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide
CID 61115052
2-[(3-amino-4-bromophenyl)sulfonyl-(2-methylpropyl)amino]acetamide
CID 115328962
N,N-diethyl-4,5-dimethoxy-2-methylbenzenesulfonamide
CID 60744825
5-amino-2-methoxy-N,N-bis(2-methylpropyl)benzenesulfonamide
CID 43587371
2-[(4-fluoro-2-methylphenyl)sulfonyl-(2-methylpropyl)amino]acetic acid
CID 62033701
4-methoxy-N,2,5-trimethyl-N-propylbenzenesulfonamide
CID 7574310

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide?
The IUPAC name of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide (CID 47064798) is 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide.
What is the SMILES notation for 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide?
The canonical SMILES for 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide is COc1cc(C)c(S(=O)(=O)N(CC(N)=O)CC(C)C)cc1C.
What is the InChIKey of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide?
The InChIKey is FBPRTPPPHNDLBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4S/c1-10(2)8-17(9-15(16)18)22(19,20)14-7-11(3)13(21-5)6-12(14)4/h6-7,10H,8-9H2,1-5H3,(H2,16,18).
What are the key properties of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide?
2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide has a molecular weight of 328.43 g/mol, XLogP of 1.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxy-2,5-dimethylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide is sourced from PubChem (CID 47064798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).